SCHEMBL1330451

SCHEMBL1330451

CCCNCC(=O)NCC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.42
ALDH1A1 P00352 4/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MAPT P10636 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
KDM4E B2RXH2 1/20 0.42
USP2 O75604 1/20 0.42
POLB P06746 1/20 0.42
CYP3A4 P08684 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
APEX1 P27695 1/20 0.42
RECQL P46063 1/20 0.42
BLM P54132 1/20 0.42
PMP22 Q01453 1/20 0.42
GPR18 Q14330 1/20 0.42
HSD17B10 Q99714 1/20 0.42
SLC6A5 Q9Y345 1/20 0.42
PAOX Q6QHF9 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20095068 0.88 GAA (0.53) FAAHALDH1A1MEN1KMT2AMAPT
SCHEMBL13336065 0.86 CA1 (0.45) FAAHALDH1A1MAPTTDP1EGLN1
SCHEMBL4975630 0.86 FAAH (0.50) FAAHALDH1A1MEN1KMT2AMAPT
SCHEMBL4985640 0.84 FAAH (0.49) FAAHALDH1A1MEN1KMT2AMAPT
SCHEMBL3419664 0.84 FAAH (0.53) FAAHALDH1A1MEN1KMT2AMAPT
SCHEMBL1380471 0.84 MCL1 (0.50) ALDH1A1MEN1KMT2AKDM4EPOLB
SCHEMBL497749 0.84
SCHEMBL22018338 0.83 FAAH (0.42) FAAHMEN1KMT2AKDM4EPOLB
SCHEMBL1329568 0.82 FAAH (0.43) FAAHALDH1A1MEN1KMT2AMAPT
SCHEMBL12268125 0.82 FAAH (0.45) FAAHMEN1KMT2APAOXGAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200392098-A1 SUBSTITUTED NAPHTHO[2,3-b]FURANS AS WATER-SOLUBLE PRODRUGS FOR PREVENTING AND/OR TREATING CANCER BOSTON BIOMEDICAL, INC. (US) 2020-12-17 US disclosed
US-10800752-B2 Substituted naphtho[2,3-b]furans as water-soluble prodrugs for preventing and/or treating cancer BOSTON BIOMEDICAL, INC. (US) 2020-10-13 US disclosed
US-20190084955-A1 SUBSTITUTED NAPHTHO[2,3-b]FURANS AS WATER-SOLUBLE PRODRUGS FOR PREVENTING AND/OR TREATING CANCER BOSTON BIOMEDICAL, INC. (US) 2019-03-21 US disclosed
US-10183925-B2 Substituted naphtho[2,3-b]furans as water-soluble prodrugs for preventing and/or treating cancer BOSTON BIOMEDICAL, INC. (US) 2019-01-22 US disclosed
US-20180111914-A1 WATER-SOLUBLE PRODRUGS BOSTON BIOMEDICAL, INC. (US) 2018-04-26 US disclosed
EP-2392579-B1 LOW-MOLECULAR POLYSULFATED HYALURONIC ACID DERIVATIVE AND MEDICINE CONTAINING SAME OTSUKA CHEMICAL CO LTD (JP) 2016-11-23 EP disclosed
US-8993536-B2 Low-molecular polysulfated hyaluronic acid derivative and medicine containing same OTSUKA CHEMICAL CO., LTD. (JP) 2015-03-31 US disclosed
EP-2392579-A1 LOW-MOLECULAR POLYSULFATED HYALURONIC ACID DERIVATIVE AND MEDICINE CONTAINING SAME Otsuka Chemical Holdings Co., Ltd. (JP) 2011-12-07 EP disclosed
US-20110281819-A1 LOW-MOLECULAR POLYSULFATED HYALURONIC ACID DERIVATIVE AND MEDICINE CONTAINING SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2011-11-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200392098-A1 SUBSTITUTED NAPHTHO[2,3-b]FURANS AS WATER-SOLUBLE PRODRUGS FOR PREVENTING AND/OR TREATING CANCER NR0B1, NR0B2, NR2C2 FAAH 4139/4885ALDH1A1 716/4885MEN1 2116/4885
US-20180111914-A1 WATER-SOLUBLE PRODRUGS NR0B2, NR0B1, AVPR1B FAAH 4001/4885ALDH1A1 654/4885MEN1 2396/4885
US-20190084955-A1 SUBSTITUTED NAPHTHO[2,3-b]FURANS AS WATER-SOLUBLE PRODRUGS FOR PREVENTING AND/OR TREATING CANCER NR0B1, NR0B2, NR2C2 FAAH 4139/4885ALDH1A1 716/4885MEN1 2116/4885
US-10800752-B2 Substituted naphtho[2,3-b]furans as water-soluble prodrugs for preventing and/or treating cancer NR0B1, NR0B2, NR2C2 FAAH 4139/4885ALDH1A1 716/4885MEN1 2116/4885
US-20110281819-A1 LOW-MOLECULAR POLYSULFATED HYALURONIC ACID DERIVATIVE AND MEDICINE CONTAINING SAME HRH1, HRH2, HRH3 FAAH 177/4885ALDH1A1 1422/4885MEN1 3443/4885
US-10183925-B2 Substituted naphtho[2,3-b]furans as water-soluble prodrugs for preventing and/or treating cancer NR0B1, NR0B2, NR2C2 FAAH 4139/4885ALDH1A1 716/4885MEN1 2116/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.